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13451-11-1 molecular structure
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tantalum(5+) ion pentabromide

ChemBase ID: 112744
Molecular Formular: Br5Ta
Molecular Mass: 580.4679
Monoisotopic Mass: 575.53968
SMILES and InChIs

SMILES:
[Br-].[Br-].[Br-].[Br-].[Br-].[Ta+5]
Canonical SMILES:
[Br-].[Br-].[Br-].[Br-].[Br-].[Ta+5]
InChI:
InChI=1S/5BrH.Ta/h5*1H;/q;;;;;+5/p-5
InChIKey:
GCPVYIPZZUPXPB-UHFFFAOYSA-I

Cite this record

CBID:112744 http://www.chembase.cn/molecule-112744.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
tantalum(5+) ion pentabromide
IUPAC Traditional name
tantalum(5+) ion pentabromide
Synonyms
TANTALUM PENTABROMIDE
Tantalum pentabromide
Tantalum(V) bromide
五溴化钽(V)
CAS Number
13451-11-1
EC Number
236-618-4
MDL Number
MFCD00049563
PubChem SID
162106807
PubChem CID
44146895

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
PubChem 44146895 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Acid pKa -8.0  H Acceptors
H Donor LogD (pH = 5.5) 1.0182534 
LogD (pH = 7.4) 1.0182534  Log P 0.797834 
Molar Refractivity 8.5991 cm3 Polarizability 3.2406807 Å3
Polar Surface Area 0.0 Å2 Rotatable Bonds
Lipinski's Rule of Five false 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Apperance
-8 Mesh Powder expand Show data source
Melting Point
265°C expand Show data source
265°C expand Show data source
Boiling Point
348°C expand Show data source
Density
4.989 expand Show data source
Storage Warning
Moisture Sensitive expand Show data source
European Hazard Symbols
Corrosive Corrosive (C) expand Show data source
X expand Show data source
UN Number
UN3260 expand Show data source
MSDS Link
Download expand Show data source
Hazard Class
8 expand Show data source
Packing Group
III expand Show data source
Risk Statements
20/21/22-34 expand Show data source
Safety Statements
22-26-36/37/39 expand Show data source
TSCA Listed
expand Show data source
GHS Pictograms
GHS05 expand Show data source
GHS06 expand Show data source
GHS Hazard statements
H301-H311-H332-H314-H318 expand Show data source
GHS Precautionary statements
P260-P301+P310-P303+P361+P353-P305+P351+P338-P361-P405-P501A expand Show data source
Purity
99.9% (metals basis) expand Show data source
Certificate of Analysis
Download expand Show data source

DETAILS

DETAILS

MP Biomedicals MP Biomedicals
MP Biomedicals - 05225622 external link
MP Biomedicals Rare Chemical collection

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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